CID 104810

Barium(2+)

Structural Information

Molecular Formula

SMILES

[Ba+2]

InChI

InChI=1S/Ba/q+2

InChIKey

XDFCIPNJCBUZJN-UHFFFAOYSA-N

Compound name

barium(2+)

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 1
References: 6198
Patents: 137.90524 Da
Monoisotopic Mass: None
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	138.912516	121.2
[M+Na]+	160.894458	128.9
[M-H]-	136.897964	121.4
[M+NH4]+	155.939063	146.4
[M+K]+	176.868398	124.3
[M+H-H2O]+	120.902500	119.1
[M+HCOO]-	182.903441	145.5
[M+CH3COO]-	196.919091	149.9
[M+Na-2H]-	158.879906	131.4
[M]+	137.90469142	119.8
[M]-	137.90578858	119.8

Literature stripe

literature stripe

Patent stripe

patents stripe